CID 13985168

4-(bromomethyl)-2-fluoropyridine

Structural Information

Molecular Formula
C6H5BrFN
SMILES
C1=CN=C(C=C1CBr)F
InChI
InChI=1S/C6H5BrFN/c7-4-5-1-2-9-6(8)3-5/h1-3H,4H2
InChIKey
QVTCEZINLKFYJJ-UHFFFAOYSA-N
Compound name
4-(bromomethyl)-2-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

195
Patents

188.95894 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.96622 131.6
[M+Na]+ 211.94816 135.8
[M+NH4]+ 206.99276 136.8
[M+K]+ 227.92210 134.9
[M-H]- 187.95166 131.3
[M+Na-2H]- 209.93361 136.1
[M]+ 188.95839 130.9
[M]- 188.95949 130.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe